From 30d0089d7075e450f6476d24f507da5a1cf9a53f Mon Sep 17 00:00:00 2001 From: Tobias Opialla Date: Tue, 29 Sep 2020 01:05:03 +0200 Subject: [PATCH] added tsv overview of columns Added tab separated value (.tsv) file to show different RIs on columns from different vendors --- 20200929 _tabulated_IdentDBs.tsv | 147 +++++++++++++++++++++++++++++++ 1 file changed, 147 insertions(+) create mode 100644 20200929 _tabulated_IdentDBs.tsv diff --git a/20200929 _tabulated_IdentDBs.tsv b/20200929 _tabulated_IdentDBs.tsv new file mode 100644 index 0000000..52b29ea --- /dev/null +++ b/20200929 _tabulated_IdentDBs.tsv @@ -0,0 +1,147 @@ +Name Ident_A Ident_B Ident_C Ident_D ID RI_Agilent RI_Restek RI_Thermo Author +Pyruvic acid_(1MEOX)(1TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 0 1047 1053 1042 MauiSILVIAPHJLK +Lactic acid_(2TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 1 1053 1065 1053 MauiSILVIAPHJLK +Valine_(1TMS)_BP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 2 1085 1087 1081 MauiSILVIAPHJLK +Alanine_(2TMS)_BP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 3 1091 1106 1096 MauiSILVIAPHJLK +Acetoacetic acid_(1MEOX)(1TMS)_BP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 4 1113 1119 1111 contrib by M. Pietzke +Glycine_(2TMS)_BP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 5 1117 1124 1116 MauiSILVIAPHJLK +Acetoacetic acid_(1MEOX)(1TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 6 1132 1139 1130 contrib by M. Pietzke +Leucine_(1TMS)_BP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 7 1153 1158 1151 MauiSILVIAPHJLK +Butanoic acid_ 3-hydroxy-_(2TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 8 1155 1167 1156 MauiSILVIAPHJLK +Butanoic acid_ 2-amino-_(2TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 9 1167 1180 1168 MauiSILVIAPHJLK +Proline_(1TMS)_BP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 10 1173 1175 1168 MauiSILVIAPHJLK +Isoleucine_(1TMS)_BP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 11 1175 1179 1172 MauiSILVIAPHJLK +Alanine_ beta-_(2TMS)_BP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 12 1189 1197 1188 MauiSILVIAPHJLK +Isobutanoic acid_ 3-amino-_(2TMS)_BP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 13 1208 1220 1208 MauiSILVIAPHJLK +Valine_(2TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 14 1213 1230 1215 MauiSILVIAPHJLK +Urea_(2TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 15 1249 1253 1247 MauiSILVIAPHJLK +Serine_(2TMS)_BP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 16 1263 1275 1262 MauiSILVIAPHJLK +Leucine_(2TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 17 1278 1295 1280 MauiSILVIAPHJLK +Glycerol_(3TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 18 1280 1303 1285 MauiSILVIAPHJLK +Pyruvic acid_ 3-hydroxy-_(1MEOX)(2TMS)_BP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 19 1295 1314 1296 MauiSILVIAPHJLK +Isoleucine_(2TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 20 1301 1319 1303 MauiSILVIAPHJLK +Threonine_(2TMS)_BP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 21 1303 1317 1303 MauiSILVIAPHJLK +Proline_(2TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 22 1305 1318 1305 MauiSILVIAPHJLK +Glycine_(3TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 23 1313 1330 1315 MauiSILVIAPHJLK +Maleic acid_(2TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 24 1314 1327 1313 MauiSILVIAPHJLK +Succinic acid_(2TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 25 1326 1336 1326 MauiSILVIAPHJLK +Glyceric acid_(3TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 26 1339 1362 1344 MauiSILVIAPHJLK +Pyruvic acid_ 3-hydroxy-_(1MEOX)(2TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 27 1346 1365 1347 MauiSILVIAPHJLK +Uracil_(2TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 28 1348 1363 1348 MauiSILVIAPHJLK +Fumaric acid_(2TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 29 1363 1369 1364 MauiSILVIAPHJLK +Alanine_(3TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 30 1366 1383 1369 MauiSILVIAPHJLK +Serine_(3TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 31 1369 1391 1374 MauiSILVIAPHJLK +Threonine_(3TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 32 1393 1417 1398 MauiSILVIAPHJLK +Thymine_(2TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 33 1408 1424 1408 MauiSILVIAPHJLK +Glutaric acid_(2TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 34 1415 1424 1416 MauiSILVIAPHJLK +Methionine_(1TMS)_BP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 35 1421 1425 1417 MauiSILVIAPHJLK +Aspartic acid_(2TMS)_BP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 36 1431 1442 1431 MauiSILVIAPHJLK +Alanine_ beta-_(3TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 37 1432 1447 1435 MauiSILVIAPHJLK +Isobutanoic acid_ 3-amino-_(3TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 38 1458 1475 1460 MauiSILVIAPHJLK +Malic acid_(3TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 39 1486 1507 1489 MauiSILVIAPHJLK +Erythritol_(4TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 40 1501 1536 1503 contrib by M. Pietzke +Putrescine_(3TMS)_BP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 41 1505 1522 1508 MauiSILVIAPHJLK +Methionine_(2TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 42 1515 1532 1515 MauiSILVIAPHJLK +Aspartic acid_(3TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 43 1516 1540 1520 MauiSILVIAPHJLK +Pyroglutamic acid_(2TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 44 1519 1534 1516 MauiSILVIAPHJLK +Cytosine_(2TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 45 1521 1537 1517 MauiSILVIAPHJLK +Butanoic acid_ 4-amino-_(3TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 46 1525 1544 1528 MauiSILVIAPHJLK +Glutamic acid_(2TMS)_BP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 47 1532 1543 1531 MauiSILVIAPHJLK +Phenylalanine_(1TMS)_BP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 48 1549 1554 1542 MauiSILVIAPHJLK +Creatinine_(3TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 49 1549 1573 1549 MauiSILVIAPHJLK +Cysteine_(3TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 50 1552 1574 1554 MauiSILVIAPHJLK +Ribose_ 2-deoxy-_(1MEOX)(3TMS)_BP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 51 1568 1600 1574 MauiSILVIAPHJLK +Ribose_ 2-deoxy-_(1MEOX)(3TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 52 1570 1601 1576 MauiSILVIAPHJLK +Serine_(4TMS)_BP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 53 1571 NA 1573 MauiSILVIAPHJLK +Glutaric acid_ 2-hydroxy-_(3TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 54 1573 1596 1577 MauiSILVIAPHJLK +Glutaric acid_ 2-oxo-_(1MEOX)(2TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 55 1577 1596 1577 MauiSILVIAPHJLK +Proline [+CO2]_(2TMS)_BP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 56 1583 1597 1580 MauiSILVIAPHJLK +Homocysteine_(2TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 57 1583 1590 1580 contrib by M. Pietzke +Hypotaurine_(3TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 58 1597 1615 1597 MauiSILVIAPHJLK +Phosphoenolpyruvic acid_(3TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 59 1597 1624 1598 MauiSILVIAPHJLK +Asparagine_(2TMS)_BP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 60 1599 1609 1595 MauiSILVIAPHJLK +Glutamic acid_(3TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 61 1618 1640 1621 MauiSILVIAPHJLK +Phenylalanine_(2TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 62 1625 1642 1624 MauiSILVIAPHJLK +Cytosine_(3TMS)_BP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 63 1625 1647 1624 MauiSILVIAPHJLK +Xylose_(1MEOX)(4TMS)_BP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 64 1640 1681 1642 MauiSILVIAPHJLK +Xylose_(1MEOX)(4TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 65 1649 1690 NA MauiSILVIAPHJLK +Homocysteine_(3TMS)_BP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 66 1662 1680 1661 contrib by M. Pietzke +Asparagine_(3TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 67 1666 1689 1667 MauiSILVIAPHJLK +Ribose_(1MEOX)(4TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 68 1669 1696 1678 MauiSILVIAPHJLK +Arabitol_(5TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 69 1708 1711 1719 MauiSILVIAPHJLK +Ribitol_(5TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 70 1713 1716 1724 MauiSILVIAPHJLK +Putrescine_(4TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 71 1729 1754 1734 MauiSILVIAPHJLK +Dihydroxyacetone phosphate_(1MEOX)(3TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 72 1739 1773 1741 MauiSILVIAPHJLK +Aconitic acid_ cis-_(3TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 73 1747 1768 1749 MauiSILVIAPHJLK +Ornithine_(3TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 74 1748 1768 1748 MauiSILVIAPHJLK +Dihydroxyacetone phosphate_(1MEOX)(3TMS)_BP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 75 1751 1785 1753 MauiSILVIAPHJLK +Glycerol-3-phosphate_(4TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 76 1756 1794 1761 MauiSILVIAPHJLK +Glutamine_(3TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 77 1771 1793 1772 MauiSILVIAPHJLK +Ethanolaminephosphate_(4TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 78 1777 1810 1780 contrib by M. Pietzke +Glutamic acid_ N-acetyl-_(2TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 79 1784 1799 1780 MauiSILVIAPHJLK +Glyceric acid-3-phosphate_(4TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 80 1802 1840 1805 MauiSILVIAPHJLK +Hypoxanthine_(2TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 81 1807 1822 NA contrib by M. Pietzke +Ornithine_(4TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 82 1812 1841 1817 MauiSILVIAPHJLK +Citric acid_(4TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 83 1814 1848 1819 MauiSILVIAPHJLK +Isocitric acid_(4TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 84 1817 1852 1822 MauiSILVIAPHJLK +Arginine [-NH3]_(3TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 85 1823 1845 1824 MauiSILVIAPHJLK +Lysine_(3TMS)_BP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 86 1851 1867 1850 MauiSILVIAPHJLK +Fructose_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 87 1862 1914 1871 MauiSILVIAPHJLK +Adenine_(2TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 88 1866 1881 1861 MauiSILVIAPHJLK +Fructose_(1MEOX)(5TMS)_BP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 89 1871 1927 1880 MauiSILVIAPHJLK +Mannose_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 90 1875 1931 1884 contrib by M. Pietzke +Tyrosine_(2TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 91 1883 1897 1890 contrib by M. Pietzke +Glucose_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 92 1885 1946 1894 MauiSILVIAPHJLK +Galactose_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 93 1887 1949 1894 MauiSILVIAPHJLK +Erythrose-4-phosphate_(1MEOX)(4TMS)_BP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 94 1893 1947 1899 MauiSILVIAPHJLK +Erythrose-4-phosphate_(1MEOX)(4TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 95 1902 1959 1910 MauiSILVIAPHJLK +Glucose_(1MEOX)(5TMS)_BP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 96 1902 1966 1914 MauiSILVIAPHJLK +Lysine_(4TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 97 1914 1950 1922 MauiSILVIAPHJLK +Sorbitol_(6TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 98 1923 1991 1939 MauiSILVIAPHJLK +Glucuronic acid_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 99 1924 2006 1936 MauiSILVIAPHJLK +Galactosamine_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 100 1927 1988 1902 contrib by M. Pietzke +Glucosamine_(1MEOX)(5TMS)_BP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 101 1927 1988 1933 contrib by M. Pietzke +Galactitol_(6TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 102 1930 1995 1945 MauiSILVIAPHJLK +Galactosamine, N-acetyl-_(1MEOX)(4TMS)_BP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 103 1933 2135 2073 contrib by M. Pietzke +Galactosamine_(1MEOX)(5TMS)_BP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 104 1933 1995 1928 contrib by M. Pietzke +Glucosamine_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 105 1933 1994 1937 contrib by M. Pietzke +Galacturonic acid_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 106 1934 1999 1960 MauiSILVIAPHJLK +Glucuronic acid_(1MEOX)(5TMS)_BP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 107 1943 1990 1954 MauiSILVIAPHJLK +Galacturonic acid_(1MEOX)(5TMS)_BP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 108 1957 1958 1968 MauiSILVIAPHJLK +Pantothenic acid_(3TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 109 1995 2032 1999 MauiSILVIAPHJLK +Gluconic acid_(6TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 110 1996 2060 2009 MauiSILVIAPHJLK +Glucosamine, N-acetyl-_(1MEOX)(4TMS)_BP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 111 2075 2127 2082 contrib by M. Pietzke +Glucosamine, N-acetyl-_(1MEOX)(4TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 112 2080 2132 2088 contrib by M. Pietzke +Inositol_ myo-_(6TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 113 2088 2140 2100 MauiSILVIAPHJLK +Uric acid_(4TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 114 2098 2142 NA contrib by M. Pietzke +Ribulose-5-phosphate_(1MEOX)(5TMS)_BP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 115 2101 2156 2110 MauiSILVIAPHJLK +Galactosamine, N-acetyl-_(1MEOX)(4TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 116 2101 2151 2108 contrib by M. Pietzke +Ribose-5-phosphate_(1MEOX)(5TMS)_BP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 117 2105 NA NA MauiSILVIAPHJLK +Ribose-5-phosphate_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 118 2109 2161 2115 MauiSILVIAPHJLK +Ribulose-5-phosphate_(1MEOX)(5TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 119 2115 2171 2125 MauiSILVIAPHJLK +Cystathionine_(2TMS)_BP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 120 2120 2138 2117 contrib by M. Pietzke +Cystathionine_(3TMS)_BP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 121 2164 2190 2150 contrib by M. Pietzke +Spermidine_(4TMS)_BP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 122 2191 2220 2193 contrib by M. Pietzke +Cystathionine_(4TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 123 2197 2247 2201 contrib by M. Pietzke +Tryptophan_(3TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 124 2206 2231 2208 MauiSILVIAPHJLK +Spermidine_(5TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 125 2246 2296 2259 contrib by M. Pietzke +Fructose-1-phosphate_(1MEOX)(6TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 126 2291 NA NA MauiSILVIAPHJLK +Fructose-6-phosphate_(1MEOX)(6TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 127 2300 2385 2316 MauiSILVIAPHJLK +Glucose-1/6-phosphate_(1MEOX)(6TMS)_MP_RI:XXXX_IDENT:C+D/A+B TRUE TRUE TRUE TRUE 128 2315 2399 2330 MauiSILVIAPHJLK +Glucose-6-phosphate_(1MEOX)(6TMS)_BP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 129 2316 2420 2331 contrib by M. Pietzke +Gluconic acid-6-phosphate_(7TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 130 2425 2512 2440 MauiSILVIAPHJLK +Uridine_(3TMS)_MP_RI:XXXX_IDENT:A+D TRUE FALSE FALSE TRUE 131 2473 2506 2468 MauiSILVIAPHJLK +Inosine_(4TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 132 2586 2647 2607 MauiSILVIAPHJLK +Sucrose_(8TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 133 2628 2718 2648 MauiSILVIAPHJLK +Adenosine_(4TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 134 2646 2687 2648 MauiSILVIAPHJLK +Spermine_(5TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 135 2668 2699 NA contrib by M. Pietzke +Lactose_(1MEOX)(8TMS)_MP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 136 2675 2738 2696 MauiSILVIAPHJLK +Lactose_(1MEOX)(8TMS)_BP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 137 2690 2768 2711 MauiSILVIAPHJLK +Fructose-1_6-diphosphate_(1MEOX)(7TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 138 2697 2795 2717 MauiSILVIAPHJLK +Fructose-1_6-diphosphate_(1MEOX)(7TMS)_BP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 139 2699 2788 2711 MauiSILVIAPHJLK +Spermine_(5TMS)_BP_RI:XXXX_IDENT:B+D FALSE TRUE FALSE TRUE 140 2713 2754 NA contrib by M. Pietzke +Maltose_(1MEOX)(8TMS)_MP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 141 2719 2779 2739 MauiSILVIAPHJLK +Trehalose_a-a-_(8TMS)_MP_RI:XXXX_IDENT:A+B TRUE TRUE FALSE FALSE 142 2726 2794 2735 MauiSILVIAPHJLK +Maltose_(1MEOX)(8TMS)_BP_RI:XXXX_IDENT:C+D FALSE FALSE TRUE TRUE 143 2744 2817 2763 MauiSILVIAPHJLK +UMP_(5TMS)_MP_RI:XXXX_IDENT:B+C FALSE TRUE TRUE FALSE 144 2878 2882 2876 contrib by M. Pietzke +AMP_(5TMS)_MP_RI:XXXX_IDENT:A+C TRUE FALSE TRUE FALSE 145 3066 3118 3057 contrib by M. Pietzke